Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 3/20 | 0.51 |
| ▸ | CASP6 | P55212 | 1/20 | 0.49 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 3/20 | 0.44 |
| ▸ | CA2 | P00918 | 3/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | APEX1 | P27695 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | PRMT1 | Q99873 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL11431004 | 0.88 | HDAC1 (0.53) | HDAC1APEX1MAPTCYP1A2CYP2C9 | |
| SCHEMBL10909707 | 0.86 | CD40 (0.45) | HDAC1CASP6CTDSP1CA1CA2 | |
| SCHEMBL11344807 | 0.86 | TIMP3 (0.48) | HDAC1CTDSP1CA1CA2CA12 | |
| SCHEMBL11428049 | 0.84 | MEN1 (0.41) | HDAC1CA1CA2APEX1MAPT | |
| SCHEMBL11440740 | 0.84 | MEN1 (0.41) | HDAC1APEX1MAPTCYP1A2CYP2C9 | |
| SCHEMBL11423374 | 0.83 | NPC1 (0.60) | CASP6CTDSP1MAPTMEN1KMT2A | |
| SCHEMBL11433031 | 0.82 | HDAC1 (0.48) | HDAC1CASP6CTDSP1CA1CA2 | |
| SCHEMBL11426294 | 0.81 | CASP6 (0.51) | HDAC1CASP6CTDSP1CA1CA2 | |
| SCHEMBL10908002 | 0.80 | DHODH (0.43) | MAPTCYP1A2CYP2C9CYP2C19MEN1 | |
| SCHEMBL11349148 | 0.80 | DHODH (0.43) | CA1CA2CA12CA9MAPT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4216165-A | Amine precursors to ureide inhibitors of connective tissue destruction | AMERICAN CYANAMID COMPANY (US) | 1980-08-05 | — | — | US | disclosed |